General Information of the Compound
| Compound ID |
CP0567778
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| Compound Name |
1-[4-[4-methoxy-5-(3,4,5-trimethoxyphenyl)pyridin-3-yl]phenyl]piperazine
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| Structure |
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| Formula |
C25H29N3O4
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| Molecular Weight |
435.524
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| Canonical SMILES |
COc1cc(cc(OC)c1OC)-c1cncc(-c2ccc(cc2)N2CCNCC2)c1OC
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| InChI |
InChI=1S/C25H29N3O4/c1-29-22-13-18(14-23(30-2)25(22)32-4)21-16-27-15-20(24(21)31-3)17-5-7-19(8-6-17)28-11-9-26-10-12-28/h5-8,13-16,26H,9-12H2,1-4H3
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| InChIKey |
JUUJZKITOSRZND-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound